Acetic Acid

Acetic Acid

SCHEMBL275637

CC(=O)O.CO.ClCCl.O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.54
LCK P06239 1/20 0.54
FYN P06241 1/20 0.54
TSHR P16473 2/20 0.44
LMNA P02545 3/20 0.36
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
CA4 P22748 2/20 0.35
SLC15A2 Q16348 1/20 0.35
TRPA1 O75762 1/20 0.33
HSD17B10 Q99714 1/20 0.33
THPO P40225 1/20 0.33
CA1 P00915 1/20 0.31
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
CES1 P23141 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Acetic Acid SCHEMBL7309563 0.96
Acetic Acid SCHEMBL59820 0.96
Acetic Acid SCHEMBL10743699 0.96 FFAR3 (0.58) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL10386503 0.96 FFAR3 (0.58) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL28661347 0.92 FFAR3 (0.54) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL17768458 0.92 FFAR3 (0.54) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL28343178 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL282406 0.92
Acetic Acid SCHEMBL5035361 0.92
Acetic Acid SCHEMBL2706810 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 88 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110297063-A A kind of quality determining method of Rhizoma Chuanxiong hair washing water extract 四川绿色本草科技发展有限公司 2019-10-01 CN claimed
CN-115792075-B Detection method of 4' -monophosphoryl lipid A compound 江苏瑞科生物技术股份有限公司 2023-11-03 CN disclosed
CN-115792075-A Detection method of 4' -monophosphoryl lipid A compound 江苏瑞科生物技术股份有限公司 2023-03-14 CN disclosed
US-9364556-B2 Drug conjugate comprising drug linked to human c-Met antibody, and use therefor KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2016-06-14 US disclosed
US-20150110815-A1 DRUG CONJUGATE COMPRISING DRUG LINKED TO HUMAN C-MET ANTIBODY, AND USE THEREFOR KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2015-04-23 US disclosed
US-8765766-B2 Pyrimidine derivatives which are antagonists of the vitronectin receptor GALAPAGOS NV (BE) 2014-07-01 US disclosed
US-20120316338-A1 Methods and Intermediates for the Preparation of Optionally Radio-Labeled Imatinib SALTER RHYS (CH) 2012-12-13 US disclosed
US-20120115883-A1 PYRIMIDINE DERIVATIVES WHICH ARE ANTAGONISTS OF THE VITRONECTIN RECEPTOR GALAPAGOS SAS 2012-05-10 US disclosed
US-8133896-B2 Pyrimidine derivatives which are antagonist of the vitronectin receptor GALAPAGOS NV (BE) 2012-03-13 US disclosed
CN-1738817-B Novel antagonist derivatives of vitronectin receptors, process for their preparation, their use as medicaments and pharmaceutical compositions containing them Galapagos S.A.S. (FR) 2011-12-21 CN disclosed
EP-0751773-A4 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1997-07-16 EP disclosed
EP-0751773-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1997-01-08 EP disclosed
US-5464788-A Stopping labor MERCK & CO., INC. (US) 1995-11-07 US disclosed
WO-1995025443-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-09-28 WO disclosed
US-5225528-A Controlling premature labor MERCK & CO., INC. (US) 1993-07-06 US disclosed
US-5190921-A Sulfates, sulfonates, phosphates, phosphonates, memory enhancement, neuroleptic agents INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1993-03-02 US disclosed
US-5071836-A A decapeptide for the treatment of gonadotrophin and steroid-related diseases; inhibits the formation of luteinizing follicle stimulating hormones HOECHST AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed
EP-0444898-A1 Cyclic hexapeptide oxytocin antagonists MERCK & CO. INC. (US) 1991-09-04 EP disclosed
US-4420424-A New peptides and a process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1983-12-13 US disclosed
US-4088537-A BIOTRANSFORMATION THE UPJOHN COMPANY (US) 1978-05-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120115883-A1 PYRIMIDINE DERIVATIVES WHICH ARE ANTAGONISTS OF THE VITRONECTIN RECEPTOR P2RY1, P2RY2, P2RX5 FFAR3 538/4885LCK 2899/4885FYN 1030/4885
US-20120316338-A1 Methods and Intermediates for the Preparation of Optionally Radio-Labeled Imatinib ABL1, PDGFRB, PDGFRA FFAR3 1803/4885LCK 63/4885FYN 366/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.